CID 4321482

1-ethoxy-4-(phenylazo)naphthalene

Structural Information

Molecular Formula
C18H16N2O
SMILES
CCOC1=CC=C(C2=CC=CC=C21)N=NC3=CC=CC=C3
InChI
InChI=1S/C18H16N2O/c1-2-21-18-13-12-17(15-10-6-7-11-16(15)18)20-19-14-8-4-3-5-9-14/h3-13H,2H2,1H3
InChIKey
DEVHJQBEBOZDPX-UHFFFAOYSA-N
Compound name
(4-ethoxynaphthalen-1-yl)-phenyldiazene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.12625 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.13353 162.3
[M+Na]+ 299.11547 169.8
[M-H]- 275.11897 172.4
[M+NH4]+ 294.16007 179.9
[M+K]+ 315.08941 165.9
[M+H-H2O]+ 259.12351 152.9
[M+HCOO]- 321.12445 190.5
[M+CH3COO]- 335.14010 175.3
[M+Na-2H]- 297.10092 171.6
[M]+ 276.12570 165.0
[M]- 276.12680 165.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.